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5-(2,3,4,5,6-Pentafluorobenzylidene)-2-(phenylimino)-4-thiazolidinone
SpectraBase Compound ID Exe6SpzvON0
InChI InChI=1S/C16H7F5N2OS/c17-10-8(11(18)13(20)14(21)12(10)19)6-9-15(24)23-16(25-9)22-7-4-2-1-3-5-7/h1-6H,(H,22,23,24)/b9-6-
InChIKey REXMFAQTGWPLPA-TWGQIWQCSA-N
Mol Weight 370.3 g/mol
Molecular Formula C16H7F5N2OS
Exact Mass 370.019925 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID I27DZAjc6Rl
Name 5-(2,3,4,5,6-Pentafluorobenzylidene)-2-(phenylimino)-4-thiazolidinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.019924841 u
Formula C16H7F5N2OS
InChI InChI=1S/C16H7F5N2OS/c17-10-8(11(18)13(20)14(21)12(10)19)6-9-15(24)23-16(25-9)22-7-4-2-1-3-5-7/h1-6H,(H,22,23,24)/b9-6-
InChIKey REXMFAQTGWPLPA-TWGQIWQCSA-N
Molecular Weight 370.297 g/mol
SMILES C1(=C(C(=C(C(=C1F)F)\C=C\1S\C(NC1=O)=N\C1=CC=CC=C1)F)F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.89507